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24-epi-cathasterone-22-O-sulfate

MNXM819802 is deprecated and replaced by MNXM14426

Properties

Image

Occurences in reactions

MNX_ID

MNXM14426

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₂₈H₄₈O₆S

charge

mass

512.31716

reference

chebi:136768

InChIKey

MMHKTOGFTDNQOU-QDUMAPLTSA-N

InChI

InChI=1S/C28H48O6S/c1-16(2)17(3)13-26(34-35(31,32)33)18(4)21-7-8-22-20-15-25(30)24-14-19(29)9-11-28(24,6)23(20)10-12-27(21,22)5/h16-24,26,29H,7-15H2,1-6H3,(H,31,32,33)/t17-,18-,19-,20-,21+,22-,23-,24+,26-,27+,28+/m0/s1

SMILES

CC(C)[C@@H](C)C[C@H](OS(=O)(=O)O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:136768 chebi:136768	24-epi-cathasterone-22-O-sulfate (22S)-3beta-hydroxy-6-oxo-5alpha-ergostan-22-yl hydrogen sulfate (3beta,5alpha,22S)-3-hydroxy-6-oxoergostan-22-yl hydrogen sulfate 24-epi-cathasterone-22-sulfate 24-epicathasterone-22-O-sulfate
sabiork.compound:31338 sabiorkM:31338	24-epi-Cathasterone-22-O-sulfate
metacyc.compound:CPD-11839 metacycM:CPD-11839 seed.compound:cpd23101 seedM:cpd23101	24-epicathasterone-22-O-sulfate
seedM:M_cpd23101	secondary/obsolete/fantasy identifier